Vitas-M small molecule compound

(2Z)-2-(1H-benzimidazol-2-yl)-3-[3-methoxy-4-(propan-2-yloxy)phenyl]prop-2-enenitrile

Catalog ID
STK394052
SMILES COc1cc(ccc1OC(C)C)/C=C(\c1nc2c([nH]1)cccc2)/C#N

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C20H19N3O2 MW 333.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N3O2/c1-13(2)25-18-9-8-14(11-19(18)24-3)10-15(12-21)20-22-16-6-4-5-7-17(16)23-20/h4-11,13H,1-3H3,(H,22,23)/b15-10-
InChIKey
DQZIINNFQYBMTI-GDNBJRDFSA-N
Synonyms

(2Z)2(1HBENZIMIDAZOL2YL)3(3METHOXY4(PROPAN2YLOXY)PHENYL)PROP2ENENITRILE
(Z)2(1HBENZIMIDAZOL2YL)3(3METHOXY4PROPAN2YLOXYPHENYL)PROP2ENENITRILE
CC(C)OC1=C(C=C(C=C1)C=C(C#N)C2=NC3=CC=CC=C3N2)OC
COc1cc(ccc1OC(C)C)C=C(c1nc2c((nH)1)cccc2)C#N
InChI=1SC20H19N3O2c113(2)25189814(1119(18)243)1015(1221)202216645717(16)2320h41113H13H3(H2223)b1510
MFCD01309684
ZINC000004067470
ZINC04067470
ZINC4067470

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Available files

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